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GROMACS 4.5.3 and PLUMED 1.2.2

Error message

  • Warning: Trying to access array offset on value of type bool in simplenews_newsletter_defaults() (line 456 of /prod_service02/web-prod/hpc-web/sites/all/modules/simplenews/simplenews.module).
  • Warning: Trying to access array offset on value of type null in simplenews_newsletter_defaults() (line 456 of /prod_service02/web-prod/hpc-web/sites/all/modules/simplenews/simplenews.module).
19/11/2010

Dear HPC Users,

GROMACS 4.5.3 is now available on SP6: the standard package (in single and
double precision) can be loaded typing "module load gromacs/4.5.3/std".

A version of mdrun/mdrun_d patched with the plugin for metadynamics simulations
PLUMED 1.2.2 is available as well: "module load gromacs/4.5.3/plumed-1.2.2".

Kind regards

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